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|---|---|---|---|---|---|---|
| 7241746 | CIF | C10 H22 Cd N6 O S2 | P 1 21/n 1 | 9.7864; 10.9611; 16.022 90; 102.095; 90 | 1680.52 | Adhikari, Suman; Bhattacharjee, Tirtha; Das, Arijit; Roy, Subhadip; Daniliuc, Constantin Gabriel; Zaręba, Jan K.; Bauzá, Antonio; Frontera, Antonio On the supramolecular properties of neutral, anionic and cationic cadmium complexes harvested from dithiolate‒polyamine binary ligand systems CrystEngComm, 2020, 22, 8023-8035 |
| 7241747 | CIF | C28 H52 Cd3 N18 S6 | P 21 21 21 | 14.6814; 17.4409; 17.6486 90; 90; 90 | 4519.04 | Adhikari, Suman; Bhattacharjee, Tirtha; Das, Arijit; Roy, Subhadip; Daniliuc, Constantin Gabriel; Zaręba, Jan K.; Bauzá, Antonio; Frontera, Antonio On the supramolecular properties of neutral, anionic and cationic cadmium complexes harvested from dithiolate‒polyamine binary ligand systems CrystEngComm, 2020, 22, 8023-8035 |
| 7241752 | CIF | C60 H82 Mn3 N6 O31 | C 1 2/c 1 | 26.891; 16.3784; 20.2907 90; 130.136; 90 | 6832.2 | Yang, Dongdong; Liu, Xiaxia; Lu, Liping; Zhu, Miaoli Effects of two different solvents on the syntheses, structural diversity, and magnetic properties of six Mn(ii) complexes derived from 3,3′-((5-carboxy-1,3-phenylene)bis(oxy))dibenzoate and variable N-donor ligands CrystEngComm, 2020, 22, 8088-8099 |
| 7241753 | CIF | C78 H57 Mn3 N6 O22 | P 1 2/c 1 | 13.706; 10.943; 23.695 90; 106.11; 90 | 3414.3 | Yang, Dongdong; Liu, Xiaxia; Lu, Liping; Zhu, Miaoli Effects of two different solvents on the syntheses, structural diversity, and magnetic properties of six Mn(ii) complexes derived from 3,3′-((5-carboxy-1,3-phenylene)bis(oxy))dibenzoate and variable N-donor ligands CrystEngComm, 2020, 22, 8088-8099 |
| 7241754 | CIF | C62 H44 Mn2 N4 O18 | P -1 | 10.2097; 10.7615; 13.8645 81.129; 79.737; 64.205 | 1344.5 | Yang, Dongdong; Liu, Xiaxia; Lu, Liping; Zhu, Miaoli Effects of two different solvents on the syntheses, structural diversity, and magnetic properties of six Mn(ii) complexes derived from 3,3′-((5-carboxy-1,3-phenylene)bis(oxy))dibenzoate and variable N-donor ligands CrystEngComm, 2020, 22, 8088-8099 |
| 7241755 | CIF | C39 H47 Mn N6 O18 | P -1 | 11.4113; 13.9536; 14.723 105.212; 92.722; 107.323 | 2139.4 | Yang, Dongdong; Liu, Xiaxia; Lu, Liping; Zhu, Miaoli Effects of two different solvents on the syntheses, structural diversity, and magnetic properties of six Mn(ii) complexes derived from 3,3′-((5-carboxy-1,3-phenylene)bis(oxy))dibenzoate and variable N-donor ligands CrystEngComm, 2020, 22, 8088-8099 |
| 7241756 | CIF | C31 H25 Mn2 N3 O12 | P 1 21/c 1 | 12.916; 8.9128; 27.161 90; 98.425; 90 | 3093 | Yang, Dongdong; Liu, Xiaxia; Lu, Liping; Zhu, Miaoli Effects of two different solvents on the syntheses, structural diversity, and magnetic properties of six Mn(ii) complexes derived from 3,3′-((5-carboxy-1,3-phenylene)bis(oxy))dibenzoate and variable N-donor ligands CrystEngComm, 2020, 22, 8088-8099 |
| 7241757 | CIF | C69 H62 Mn3 N6 O23 | C 1 2/c 1 | 28.4052; 16.0847; 19.9257 90; 133.158; 90 | 6641 | Yang, Dongdong; Liu, Xiaxia; Lu, Liping; Zhu, Miaoli Effects of two different solvents on the syntheses, structural diversity, and magnetic properties of six Mn(ii) complexes derived from 3,3′-((5-carboxy-1,3-phenylene)bis(oxy))dibenzoate and variable N-donor ligands CrystEngComm, 2020, 22, 8088-8099 |
| 7241764 | CIF | C16 H80 Cl8 I16 N16 Pb4 | P b c m | 8.759; 9.44; 23.545 90; 90; 90 | 1946.82 | Fazayeli, Monireh; Khatamian, Maasoumeh; Cruciani, Giuseppe Anomalous inclusion of chloride ions in ethylenediammonium lead iodide turns 1D non-perovskite into a 2D perovskite structure CrystEngComm, 2020, 22, 8063-8071 |
| 7241928 | CIF | C5 H12 | P b c n | 3.7996; 8.2477; 14.205 90; 90; 90 | 445.16 | Liu, X.; Pulham, C. R. Pressure-induced phase separation of miscible liquids: 1 : 1 n-pentane/iso-pentane CrystEngComm, 2020, 22, 8251-8255 |
| 7241997 | CIF | C13 H38 Mg2 N2 O21 Pt S4 | P n m a | 10.4292; 15.3858; 26.9006 90; 90; 90 | 4316.51 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
| 7241998 | CIF | C10 H32 N2 Ni2 O20 Pt S4 | P -1 | 6.2643; 13.6027; 14.2439 117.142; 92.957; 99.353 | 1054.74 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
| 7241999 | CIF | C10 H16 Cd2 N2 O12 Pt S4 | P -1 | 6.7533; 7.4688; 11.335 103.51; 97.371; 103.462 | 530.45 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
| 7242000 | CIF | C10 H26 Mn2 N2 O17 Pt S4 | C 1 2/c 1 | 25.8063; 10.7668; 23.2567 90; 90.72; 90 | 6461.4 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
| 7242001 | CIF | C10 H16 N2 O12 Pt S4 Sr2 | P -1 | 6.8663; 7.9281; 11.5395 94.147; 101.197; 114.893 | 550.53 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
| 7242002 | CIF | C10 H36 Fe2 N2 O22 Pt S4 | P 1 21/n 1 | 6.319; 13.7134; 16.9778 90; 97.989; 90 | 1456.93 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
| 7242003 | CIF | C10 H32 Co2 N2 O20 Pt S4 | P -1 | 6.2781; 13.6869; 14.2519 117.626; 92.748; 100.521 | 1054.34 | Liebing, Phil; Oehler, Florian; Witzorke, Juliane; Schmeide, Marten From zero- to three-dimensional heterobimetallic coordination polymers with the [Pt{SSC-N(CH2COO)2}2]4− metalloligand CrystEngComm, 2020, 22, 7838-7846 |
| 7242004 | CIF | C25 H18 N4 O8 Sm | P -1 | 10.5366; 10.7815; 12.2029 97.258; 98.196; 117.932 | 1182.32 | Liu, Dongmei; Dong, Gaoyun; Wang, Xiong; Nie, Fengmei; Li, Xia A luminescent Eu coordination polymer with near-visible excitation for sensing and its homologues constructed from 1,4-benzenedicarboxylate and 1H-imidazo[4,5-f][1,10]-phenanthroline CrystEngComm, 2020, 22, 7877-7887 |
| 7242005 | CIF | C50 H37 Dy2 N8 O16.5 | P -1 | 10.4665; 10.692; 12.2202 96.974; 98.572; 117.604 | 1169.68 | Liu, Dongmei; Dong, Gaoyun; Wang, Xiong; Nie, Fengmei; Li, Xia A luminescent Eu coordination polymer with near-visible excitation for sensing and its homologues constructed from 1,4-benzenedicarboxylate and 1H-imidazo[4,5-f][1,10]-phenanthroline CrystEngComm, 2020, 22, 7877-7887 |
| 7242006 | CIF | C25 H18 N4 O8 Tb | P -1 | 10.4833; 10.712; 12.2096 97.082; 98.465; 117.663 | 1172.06 | Liu, Dongmei; Dong, Gaoyun; Wang, Xiong; Nie, Fengmei; Li, Xia A luminescent Eu coordination polymer with near-visible excitation for sensing and its homologues constructed from 1,4-benzenedicarboxylate and 1H-imidazo[4,5-f][1,10]-phenanthroline CrystEngComm, 2020, 22, 7877-7887 |
| 7242007 | CIF | C25 H18 Eu N4 O8 | P -1 | 10.5279; 10.7664; 12.2112 97.308; 98.164; 117.842 | 1181.5 | Liu, Dongmei; Dong, Gaoyun; Wang, Xiong; Nie, Fengmei; Li, Xia A luminescent Eu coordination polymer with near-visible excitation for sensing and its homologues constructed from 1,4-benzenedicarboxylate and 1H-imidazo[4,5-f][1,10]-phenanthroline CrystEngComm, 2020, 22, 7877-7887 |
| 7242008 | CIF | C25 H18 Gd N4 O8 | P -1 | 10.502; 10.7425; 12.2129 97.093; 98.38; 117.775 | 1176.88 | Liu, Dongmei; Dong, Gaoyun; Wang, Xiong; Nie, Fengmei; Li, Xia A luminescent Eu coordination polymer with near-visible excitation for sensing and its homologues constructed from 1,4-benzenedicarboxylate and 1H-imidazo[4,5-f][1,10]-phenanthroline CrystEngComm, 2020, 22, 7877-7887 |
| 7242015 | CIF | C26 H28 N4 O6 | C 1 2/c 1 | 13.864; 12.086; 14.994 90; 111.62; 90 | 2336 | Tripathi, Suparna; Islam, Samiul; Seth, Saikat Kumar; Bauzá, Antonio; Frontera, Antonio; Mukhopadhyay, Subrata Supramolecular assemblies involving salt bridges: DFT and X-ray evidence of bipolarity CrystEngComm, 2020, 22, 8171-8181 |
| 7242016 | CIF | C20 H18 N2 O5 | P 1 21/n 1 | 7.075; 19.857; 12.811 90; 94.991; 90 | 1793 | Tripathi, Suparna; Islam, Samiul; Seth, Saikat Kumar; Bauzá, Antonio; Frontera, Antonio; Mukhopadhyay, Subrata Supramolecular assemblies involving salt bridges: DFT and X-ray evidence of bipolarity CrystEngComm, 2020, 22, 8171-8181 |
| 7242017 | CIF | C26 H28 N4 O6 | P -1 | 6.855; 7.642; 24.281 90.019; 92.555; 107.022 | 1214.9 | Tripathi, Suparna; Islam, Samiul; Seth, Saikat Kumar; Bauzá, Antonio; Frontera, Antonio; Mukhopadhyay, Subrata Supramolecular assemblies involving salt bridges: DFT and X-ray evidence of bipolarity CrystEngComm, 2020, 22, 8171-8181 |
| 9000013 | CIF | Al3 H6 K O14 S2 | R -3 m :H | 6.96; 6.96; 17.35 90; 90; 120 | 727.861 | Hendricks, S. B. The crystal structures of alunite and the jarosites American Mineralogist, 1937, 22, 773-784 |
| 9000014 | CIF | Al2 Ca3 O12 Si2.001 | I a -3 d | 12.14; 12.14; 12.14 90; 90; 90 | 1789.19 | Pabst, A. The crystal structure of plazolite American Mineralogist, 1937, 22, 861-868 |
| 9004171 | CIF | C Al F5 O3 Sr2 | P 1 21/n 1 | 5.45; 8.704; 13.15 90; 98.72; 90 | 616.584 | Hawthorne, F. C. The crystal structure of stenonite and the classification of the aluminofluoride minerals The Canadian Mineralogist, 1984, 22, 245-251 |
| 9004172 | CIF | Al3 Ca0.06 K0.51 Na3.25 O14.67 S0.24 Si3 | P 63 | 12.685; 12.685; 5.179 90; 90; 120 | 721.701 | Hassan, I.; Grundy, H. D. The character of the cancrinite-vishnevite solid-solution series The Canadian Mineralogist, 1984, 22, 333-349 |
| 9004173 | CIF | Fe2 H11 O15 Se3 | P 1 21/c 1 | 16.81; 7.88; 10.019 90; 98.26; 90 | 1313.38 | Hawthorne, F. C. The crystal structure of mandarinoite, Fe2Se3O9.6H2O The Canadian Mineralogist, 1984, 22, 475-480 |
| 9004174 | CIF | H2 O4 W | P m n b | 5.249; 10.711; 5.133 90; 90; 90 | 288.588 | Szymanski, J. T.; Roberts, A. C. The crystal structure of tungstite, WO3.H2O The Canadian Mineralogist, 1984, 22, 681-688 |
| 9006316 | CIF | Fe2 O3 | F d -3 m :2 | 8.33; 8.33; 8.33 90; 90; 90 | 578.01 | Pecharroman, C.; Gonzalez-Carreno T; Iglesias, J. E. The infrared dielectric properties of maghemite, gamma-Fe2O3, from reflectance measurement on pressed powders Sample: a) idealized Physics and Chemistry of Minerals, 1995, 22, 21-29 |
| 9006317 | CIF | Fe2 O3 | P 41 3 2 | 8.33; 8.33; 8.33 90; 90; 90 | 578.01 | Pecharroman, C.; Gonzalez-Carreno T; Iglesias, J. E. The infrared dielectric properties of maghemite, gamma-Fe2O3, from reflectance measurement on pressed powders Sample: b) idealized Physics and Chemistry of Minerals, 1995, 22, 21-29 |
| 9006318 | CIF | Fe3 O4 | P 43 21 2 | 8.33; 8.33; 24.99 90; 90; 90 | 1734.03 | Pecharroman, C.; Gonzalez-Carreno T; Iglesias, J. E. The infrared dielectric properties of maghemite, gamma-Fe2O3, from reflectance measurement on pressed powders Sample: c) idealized, either one of Fe-oct 1-6, or both Fe-oct 6-7 have zero occupancy Physics and Chemistry of Minerals, 1995, 22, 21-29 |
| 9006319 | CIF | Al1.99 Ca0.24 Cr0.01 Fe1.59 Mg1.119 Mn0.039 O12 Si3 Ti0.01 | I a -3 d | 11.533; 11.533; 11.533 90; 90; 90 | 1534.01 | Quartieri, S.; Chaboy, J.; Merli, M.; Oberti, R.; Ungaretti, L. Local structural environment of calcium in garnets: A combined structure-refinement and XANES investigation Note: sample MP14 Physics and Chemistry of Minerals, 1995, 22, 159-169 |
| 9006320 | CIF | Al2 Ca0.51 Fe1.431 Mg1.02 Mn0.039 O12 Si3 | I a -3 d | 11.565; 11.565; 11.565 90; 90; 90 | 1546.81 | Quartieri, S.; Chaboy, J.; Merli, M.; Oberti, R.; Ungaretti, L. Local structural environment of calcium in garnets: A combined structure-refinement and XANES investigation Note: sample MP18 Physics and Chemistry of Minerals, 1995, 22, 159-169 |
| 9006321 | CIF | Al1.99 Ca0.51 Fe1.56 Mg0.921 Mn0.039 O12 Si3 Ti0.01 | I a -3 d | 11.571; 11.571; 11.571 90; 90; 90 | 1549.22 | Quartieri, S.; Chaboy, J.; Merli, M.; Oberti, R.; Ungaretti, L. Local structural environment of calcium in garnets: A combined structure-refinement and XANES investigation Note: sample MP12 Physics and Chemistry of Minerals, 1995, 22, 159-169 |
| 9006322 | CIF | Al1.99 Ca1.389 Fe0.469 Mg1.14 Mn0.009 O12 Si3 | I a -3 d | 11.663; 11.663; 11.663 90; 90; 90 | 1586.47 | Quartieri, S.; Chaboy, J.; Merli, M.; Oberti, R.; Ungaretti, L. Local structural environment of calcium in garnets: A combined structure-refinement and XANES investigation Sample: SBB Physics and Chemistry of Minerals, 1995, 22, 159-169 |
| 9006323 | CIF | Al1.87 Ca2.139 Fe0.849 Mg0.09 Mn0.039 O12 Si3 Ti0.01 | I a -3 d | 11.787; 11.787; 11.787 90; 90; 90 | 1637.61 | Quartieri, S.; Chaboy, J.; Merli, M.; Oberti, R.; Ungaretti, L. Local structural environment of calcium in garnets: A combined structure-refinement and XANES investigation Note: sample VOL Physics and Chemistry of Minerals, 1995, 22, 159-169 |
| 9006324 | CIF | Al Ca2.889 Fe0.949 Mn0.039 O12 Si3 Ti0.12 | I a -3 d | 11.967; 11.967; 11.967 90; 90; 90 | 1713.78 | Quartieri, S.; Chaboy, J.; Merli, M.; Oberti, R.; Ungaretti, L. Local structural environment of calcium in garnets: A combined structure-refinement and XANES investigation Note: sample BRIC Physics and Chemistry of Minerals, 1995, 22, 159-169 |
| 9006325 | CIF | Al1.81 Ca2.901 Fe0.22 Mg0.06 Mn0.009 O12 Si3 Ti0.01 | I a -3 d | 11.871; 11.871; 11.871 90; 90; 90 | 1672.87 | Quartieri, S.; Chaboy, J.; Merli, M.; Oberti, R.; Ungaretti, L. Local structural environment of calcium in garnets: A combined structure-refinement and XANES investigation Note: sample GRO Physics and Chemistry of Minerals, 1995, 22, 159-169 |
| 9006326 | CIF | Al2.8 Ba0.01 Fe0.08 H2 K0.9 Mg0.04 Na0.07 O12 Si3.04 Ti0.04 | C 1 2/c 1 | 5.194; 9.013; 20.064 90; 95.8; 90 | 934.458 | Comodi, P.; Zanazzi, P. F. High-pressure structural study of muscovite Sample: K-Ms, P = 0.05 GPa Physics and Chemistry of Minerals, 1995, 22, 170-177 |
| 9006327 | CIF | Al2.8 Ba0.01 Fe0.08 H2 K0.9 Mg0.04 Na0.07 O12 Si3.04 Ti0.04 | C 1 2/c 1 | 5.151; 8.931; 19.399 90; 95.8; 90 | 887.855 | Comodi, P.; Zanazzi, P. F. High-pressure structural study of muscovite Sample: K-Ms, P = 2.80 GPa Physics and Chemistry of Minerals, 1995, 22, 170-177 |
| 9006328 | CIF | Al2.8 Fe0.1 H2 K0.6 Mg0.04 Na0.37 O12 Si3.04 Ti0.02 | C 1 2/c 1 | 5.165; 8.964; 19.798 90; 95.4; 90 | 912.561 | Comodi, P.; Zanazzi, P. F. High-pressure structural study of muscovite Sample: Na-Ms, P = 0.0001 GPa, in air Physics and Chemistry of Minerals, 1995, 22, 170-177 |
| 9006329 | CIF | Al2.8 Fe0.1 H2 K0.6 Mg0.04 Na0.37 O12 Si3.04 Ti0.02 | C 1 2/c 1 | 5.13; 8.886; 19.241 90; 95.5; 90 | 873.066 | Comodi, P.; Zanazzi, P. F. High-pressure structural study of muscovite Sample: Na-Ms, P = 2.7 GPa Physics and Chemistry of Minerals, 1995, 22, 170-177 |
| 9006330 | CIF | H2 Mg O2 | P -3 m 1 | 3.14979; 3.14979; 4.7702 90; 90; 120 | 40.986 | Catti, M.; Ferraris, G.; Hull, S.; Pavese, A. Static compression and H disorder in brucite, Mg(OH)2, to 11 GPa: a powder neutron diffraction study Sample: at P = 0.0001 GPa Physics and Chemistry of Minerals, 1995, 22, 200-206 |
| 9006331 | CIF | H2 Mg O2 | P -3 m 1 | 3.0698; 3.0698; 4.429 90; 90; 120 | 36.146 | Catti, M.; Ferraris, G.; Hull, S.; Pavese, A. Static compression and H disorder in brucite, Mg(OH)2, to 11 GPa: a powder neutron diffraction study Sample: at P = 7.8 GPa Physics and Chemistry of Minerals, 1995, 22, 200-206 |
| 9006332 | CIF | H2 Mg O2 | P -3 m 1 | 3.0467; 3.0467; 4.3554 90; 90; 120 | 35.012 | Catti, M.; Ferraris, G.; Hull, S.; Pavese, A. Static compression and H disorder in brucite, Mg(OH)2, to 11 GPa: a powder neutron diffraction study Sample: at P = 10.9 GPa Physics and Chemistry of Minerals, 1995, 22, 200-206 |
| 9006333 | CIF | H2 Mg O2 | P -3 m 1 | 3.0464; 3.0464; 4.3553 90; 90; 120 | 35.004 | Catti, M.; Ferraris, G.; Hull, S.; Pavese, A. Static compression and H disorder in brucite, Mg(OH)2, to 11 GPa: a powder neutron diffraction study Sample: at P = 10.9 GPa, split H site Physics and Chemistry of Minerals, 1995, 22, 200-206 |
| 9006334 | CIF | Ca Fe3 O12 Ti4 | I m -3 | 7.46718; 7.46718; 7.46718 90; 90; 90 | 416.361 | Leinenweber, K.; Linton, J.; Navrotsky, A.; Fei, Y.; Parise, J. B. High-pressure perovskites on the join CaTiO3-FeTiO3 Physics and Chemistry of Minerals, 1995, 22, 251-258 |
| 9006335 | CIF | Fe O3 Ti | R 3 c :H | 5.12334; 5.12334; 13.7602 90; 90; 120 | 312.796 | Leinenweber, K.; Linton, J.; Navrotsky, A.; Fei, Y.; Parise, J. B. High-pressure perovskites on the join CaTiO3-FeTiO3 Physics and Chemistry of Minerals, 1995, 22, 251-258 |
| 9006336 | CIF | Mg0.78 O3 Si1.06 | P 63 c m | 5.073; 5.073; 14.013 90; 90; 120 | 312.314 | Kudoh, Y.; Nagase, T.; Sasaki, S.; Tanaka, M.; Kanzaki, M. Phase F, a new hydrous magnesium silicate synthesized at 1000 C and 17 GPa: Crystal structure and estimated bulk modulus Note: The authors withdrew this structure, it is not Phase-F See PCM 24 (1997) 610 Physics and Chemistry of Minerals, 1995, 22, 295-299 |
| 9006337 | CIF | Mg O3 Si | P b c a | 18.251; 8.814; 5.181 90; 90; 90 | 833.438 | Yang, H.; Ghose, S. High temperature single crystal X-ray diffraction studies of the ortho-proto phase transition in enstatite, Mg2Si2O6 at 1360 K Sample: T = 296 K Physics and Chemistry of Minerals, 1995, 22, 300-310 |
| 9006338 | CIF | Mg O3 Si | P b c a | 18.341; 8.889; 5.219 90; 90; 90 | 850.87 | Yang, H.; Ghose, S. High temperature single crystal X-ray diffraction studies of the ortho-proto phase transition in enstatite, Mg2Si2O6 at 1360 K Sample: T = 900 K Physics and Chemistry of Minerals, 1995, 22, 300-310 |
| 9006339 | CIF | Mg O3 Si | P b c a | 18.413; 8.929; 5.246 90; 90; 90 | 862.493 | Yang, H.; Ghose, S. High temperature single crystal X-ray diffraction studies of the ortho-proto phase transition in enstatite, Mg2Si2O6 at 1360 K Sample: T = 1200 K Physics and Chemistry of Minerals, 1995, 22, 300-310 |
| 9006340 | CIF | Mg O3 Si | P b c a | 18.456; 8.96; 5.27 90; 90; 90 | 871.478 | Yang, H.; Ghose, S. High temperature single crystal X-ray diffraction studies of the ortho-proto phase transition in enstatite, Mg2Si2O6 at 1360 K Sample: T = 1360 K Physics and Chemistry of Minerals, 1995, 22, 300-310 |
| 9006341 | CIF | Mg O3 Si | P b c n | 9.306; 8.886; 5.36 90; 90; 90 | 443.235 | Yang, H.; Ghose, S. High temperature single crystal X-ray diffraction studies of the ortho-proto phase transition in enstatite, Mg2Si2O6 at 1360 K Sample: T = 1360 K Physics and Chemistry of Minerals, 1995, 22, 300-310 |
| 9006342 | CIF | Mg O3 Si | P b c n | 9.315; 8.899; 5.365 90; 90; 90 | 444.727 | Yang, H.; Ghose, S. High temperature single crystal X-ray diffraction studies of the ortho-proto phase transition in enstatite, Mg2Si2O6 at 1360 K Sample: T = 1400 K Physics and Chemistry of Minerals, 1995, 22, 300-310 |
| 9006343 | CIF | Al3 Ca Cl1.12 K0.99 Na2.01 O13.76 S0.44 Si3 | P 63 | 12.784; 12.784; 5.346 90; 90; 120 | 756.647 | Bonaccorsi, E.; Comodi, P.; Merlino, S. Thermal behaviour of davyne-group minerals Sample: T = 293 K Physics and Chemistry of Minerals, 1995, 22, 367-374 |
| 9006344 | CIF | Al3 Ca Cl1.12 K0.99 Na2.01 O13.5 S0.44 Si3 | P 63/m | 12.871; 12.871; 5.371 90; 90; 120 | 770.567 | Bonaccorsi, E.; Comodi, P.; Merlino, S. Thermal behaviour of davyne-group minerals Sample: T = 943 K Physics and Chemistry of Minerals, 1995, 22, 367-374 |
| 9006345 | CIF | Na2 O7 Si3 | C 1 2/c 1 | 8.922; 4.849; 11.567 90; 102.64; 90 | 488.292 | Fleet, M. E.; Henderson, G. S. Soidium trisilicate: A new high-pressure silicate structure (Na2Si[Si2O7]) Physics and Chemistry of Minerals, 1995, 22, 383-386 |
| 9006346 | CIF | Al K O8 Si3 | C 1 2/m 1 | 8.58804; 13.00492; 7.19238 90; 116.026; 90 | 721.836 | Tseng, H.-Y.; Heaney, P. J.; Onstott, T. C. Characterization of lattice strain induced by neutron irradiation Sample: Unirradiated Physics and Chemistry of Minerals, 1995, 22, 399-405 |
| 9006347 | CIF | Al K O8 Si3 | C 1 2/m 1 | 8.59122; 13.00089; 7.19192 90; 116.009; 90 | 721.938 | Tseng, H.-Y.; Heaney, P. J.; Onstott, T. C. Characterization of lattice strain induced by neutron irradiation Sample: neutron dose = 6.3*10^18 n/cm2 Physics and Chemistry of Minerals, 1995, 22, 399-405 |
| 9006348 | CIF | Al K O8 Si3 | C 1 2/m 1 | 8.59046; 12.99323; 7.18763 90; 115.99; 90 | 721.135 | Tseng, H.-Y.; Heaney, P. J.; Onstott, T. C. Characterization of lattice strain induced by neutron irradiation Sample: neutron dose = 1.26*10^19 n/cm2 Physics and Chemistry of Minerals, 1995, 22, 399-405 |
| 9007490 | CIF | C H2 Cu2 O5 | P 1 21/a 1 | 9.502; 11.974; 3.24 90; 98.75; 90 | 364.347 | Susse, P. Verfeinerung der kristallstruktur des malachits, Cu2(OH)2CO3 Acta Crystallographica, 1967, 22, 146-151 |
| 9009578 | CIF | Al1.2 Ca1.58 H30 O46.9 Si16.8 | C 1 2/m 1 | 17.646; 17.898; 7.397 90; 116.37; 90 | 2093.09 | Alberti, A. The crystal structure of two clinoptilolites Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 25-37 |
| 9009579 | CIF | Al1.6 H30 Na2.06 O47.56 Si16.4 | C 1 2/m 1 | 17.641; 18.031; 7.402 90; 116.43; 90 | 2108.37 | Alberti, A. The crystal structure of two clinoptilolites Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 25-37 |
| 9009580 | CIF | Al6.3 Ca2.759 H48 K0.215 Na0.677 O51.24 Si11.7 | R -3 m :H | 13.338; 13.338; 23.014 90; 90; 120 | 3545.72 | Merlino, S.; Galli, E.; Alberti, A. The crystal structure of levyne Note: a zeolite mineral Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 117-129 |
| 9009581 | CIF | C2 Cl Mg Na3 O6 | F d -3 :2 | 14.069; 14.069; 14.069 90; 90; 90 | 2784.77 | Dal Negro, A.; Giuseppetti, G.; Tadini, C. Refinement of the crystal structure of northupite: Na3Mg(CO3)2Cl Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 158-163 |
| 9009582 | CIF | As2 Cu O4 | P 42/m b c | 8.592; 8.592; 5.573 90; 90; 90 | 411.413 | Pertlik, F. Verfeinerung der kristallstruktur von synthetischem trippkeit, CuAs2O4 Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 211-217 |
| 9009583 | CIF | Fe O4 Sb2 | P 42/m b c | 8.59; 8.59; 5.913 90; 90; 90 | 436.309 | Fischer, R.; Pertlik, F. Verfeinerung der kristallstruktur des schafarzikites, FeSb2O4 Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 236-241 |
| 9009584 | CIF | Cu S | P 63/m m c | 3.796; 3.796; 16.36 90; 90; 120 | 204.158 | Kalbskopf, R.; Pertlik, F.; Zemann, J. Verfeinerung der kristallstruktur des covellins, CuS, mit einkristalldaten Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 242-249 |
| 9009585 | CIF | Al0.67 Be2 Ca Fe0.6 H7 Mg1.4 O17 P3 | C 1 2/c 1 | 15.874; 11.854; 6.605 90; 95.43; 90 | 1237.29 | Fanfani, L.; Nunzi, A.; Zananni, P. F.; Zanzari, A. R. The crystal structure of roscherite Tschermaks Mineralogische und Petrographische Mitteilungen, 1975, 22, 266-277 |
| 9009659 | CIF | N Na O3 | R -3 c :H | 5.0718; 5.0718; 16.8336 90; 90; 120 | 375.001 | Ahtee, M.; Nurmela, M.; Suortti, P.; Jarvinen, M. Correction for preferred orientation in Rietveld refinement Sample: II, refined with correction for texture Note: Synthetic sample Journal of Applied Crystallography, 1989, 22, 261-268 |
| 9009895 | CIF | Ni1.5 Se0.5 Te0.5 | P 4/n m m :1 | 3.745; 3.745; 5.779 90; 90; 90 | 81.051 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase A, sample 12 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009896 | CIF | Ni1.4 Se0.5 Te0.5 | P 4/n m m :1 | 3.734; 3.734; 5.757 90; 90; 90 | 80.268 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase A, sample 34 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009897 | CIF | Ni0.99 Se1.01 | P 63/m m c | 3.661; 3.661; 5.356 90; 90; 120 | 62.169 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase F, sample 83 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009898 | CIF | Ni0.984 Se0.816 Te0.2 | P 63/m m c | 3.722; 3.722; 5.35 90; 90; 120 | 64.186 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase F, sample 84 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009899 | CIF | Ni0.976 Se0.624 Te0.4 | P 63/m m c | 3.784; 3.784; 5.35 90; 90; 120 | 66.342 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase F, sample 86 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009900 | CIF | Ni0.98 Se0.51 Te0.51 | P 63/m m c | 3.822; 3.822; 5.35 90; 90; 120 | 67.681 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase F, sample 85 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009901 | CIF | Ni0.966 Se0.4 Te0.634 | P 63/m m c | 3.854; 3.854; 5.35 90; 90; 120 | 68.819 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase F, sample 87 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009902 | CIF | Ni0.96 Se0.2 Te0.84 | P 63/m m c | 3.909; 3.909; 5.35 90; 90; 120 | 70.797 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase F, sample 89 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009903 | CIF | Ni0.958 Te1.042 | P 63/m m c | 3.969; 3.969; 5.358 90; 90; 120 | 73.096 | Rost, E.; Vestersjo, E. On the system Ni-Se-Te Note: Phase F, sample 90 Acta Chemica Scandinavica, 1968, 22, 2118-2134 |
| 9009904 | CIF | Cl Hg2 O | C 1 2/c 1 | 19.515; 5.915; 9.478 90; 143.81; 90 | 646.002 | Aurivillius, K.; Folkmarson, L. The crystal structure of terlinguaite Hg4O2Cl2 Acta Chemica Scandinavica, 1968, 22, 2529-2540 |
| 9011063 | CIF | O3 S | P 21 n b | 5.191; 10.82; 12.384 90; 90; 90 | 695.567 | McDonald, W. S.; Cruickshank, D. W. J. A refinement of the structure of S3O9 Acta Crystallographica, 1967, 22, 48-51 |
| 9011064 | CIF | Al H24 Na O20 S2 | P a -3 | 12.213; 12.213; 12.213 90; 90; 90 | 1821.66 | Cromer, D. T.; Kay, M. I.; Larson, A. C. Refinement of the alum structures. II. X-ray and neutron diffraction of NaAl(SO4)2*12H2O, gamma alum Locality: synthetic Acta Crystallographica, 1967, 22, 182-187 |
| 9011066 | CIF | C7 H4 O | P 1 21/a 1 | 15.81; 3.942; 7.895 90; 102.72; 90 | 479.964 | Prakash, A. Refinement of the crystal structure of anthraquinone Acta Crystallographica, 1967, 22, 439-440 |
| 9011067 | CIF | Fe6.3 K1.8 Mn0.7 Na1.2 Nb0.2 O31 Si8 Sn0.1 Ti1.6 Zr0.1 | A -1 | 5.36; 11.76; 21.07999 85.13; 90; 103.22 | 1288.61 | Woodrow, P. J. The crystal structure of astrophyllite Acta Crystallographica, 1967, 22, 673-678 |
| 9011068 | CIF | Mn | I -4 3 m | 8.9125; 8.9125; 8.9125 90; 90; 90 | 707.944 | Gazzara, C. P.; Middleton, R. M.; Weiss, R. J.; Hall, E. O. A refinement of the parameters of alpha manganese Localilty: synthetic Sample: at T = 298K Acta Crystallographica, 1967, 22, 859-862 |
| 9011772 | CIF | Al0.33 Ca0.04 Fe1.39 H2 K0.78 Mg0.61 O12 Si3.67 | C 1 2/m 1 | 5.2; 9; 10.25 90; 100.1; 90 | 472.266 | Zhukhlistov, A. P.; Zvyagin, B. B.; Lazarenko, E. K.; Pavlishin, V. I. Refinement of the crystal structure of ferrous seladonite Kristallografiya, 1977, 22, 498-504 |
| 9011868 | CIF | B2 Ca H10 O9 | P -1 | 7.845; 6.525; 8.124 111.62; 111.19; 73.44 | 354.887 | Kazanskaya, E. V.; Chemodina, T. N.; Egorov-Tismenko Y K; Simonov, M. A.; Belov, N. V. Refined crystal structure of pentahydroborite Ca(B2O(OH)6)*(H2O)2 Soviet Physics Crystallography, 1977, 22, 35-36 |
| 9011869 | CIF | Cu1.6 Hg0.875 S4 Sn Zn0.28 | I -4 2 m | 5.542; 5.542; 10.908 90; 90; 90 | 335.026 | Kaplunnik, L. N.; Pobedimskaya, E. A.; Belov, N. V. Crystal structure of velikite Cu3.75Hg1.75Sn2S8 Soviet Physics Crystallography, 1977, 22, 99-100 |
| 9011870 | CIF | B3 Ca2 Cl H4 O8 | P 1 1 21/b | 7.975; 12.571; 7.237 90; 90; 86.14 | 723.89 | Yamnova, N. A.; Simonov, M. A.; Belov, N. V. Refined crystal structure of solongoite Ca2[B3O4(OH)4]Cl Soviet Physics Crystallography, 1977, 22, 356-357 |
| 9011871 | CIF | Bi Fe2 H O9 Si2 | C 1 m 1 | 5.21; 9.02; 7.74 90; 100.667; 90 | 357.45 | Zhukhlistov, A. P.; Zvyagin, B. B. Determination of the crystal structures of chapmanite and bismuthoferrite by high-voltage electron diffraction Soviet Physics Crystallography, 1977, 22, 419-423 |
| 9011872 | CIF | Fe2 H O9 Sb Si2 | C 1 m 1 | 5.19; 8.99; 7.7 90; 100.67; 90 | 353.056 | Zhukhlistov, A. P.; Zvyagin, B. B. Determination of the crystal structures of chapmanite and bismuthoferrite by high-voltage electron diffraction Note: z(O3) corrected Soviet Physics Crystallography, 1977, 22, 419-423 |
| 9011895 | CIF | Na5 O13 P Si2 Ti2 | P -1 | 5.49; 7.11; 14.5 101; 96; 90 | 552.434 | Belov, N. V.; Gavrilova, G. S.; Solov'eva, L. P.; Khalilov, A. D. The refined structure of lomonosovite Soviet Physics Doklady, 1977, 22, 422-424 |
| 9011896 | CIF | B5 Ca2 Cl H2 O10 | P 1 | 6.463; 6.564; 6.302 61.63; 118.77; 105.78 | 205.878 | Rumanova, I. M.; Iorysh, Z. I.; Belov, N. V. Crystal structure of triclinic chilgardite Ca2[B5O9]Cl*H2O = Ca2[B3±B2deltaO9]Cl*H2O Soviet Physics Doklady, 1977, 22, 460-462 |
| 9012000 | CIF | Cl3 Fe | R -3 :H | 6.065; 6.065; 17.42 90; 90; 120 | 554.933 | Hashimoto, S.; Forster, K.; Moss, S. C. Structure refinement of an FeCl3 crystal using a thin plate sample Journal of Applied Crystallography, 1988, 22, 173-180 |
| 9012136 | CIF | Ca10.115 Mg0.385 O28 P7 | R 3 c :H | 10.401; 10.401; 37.316 90; 90; 120 | 3496.04 | Schroeder, L. W.; Dickens, B.; Brown, W. E. Crystallographic studies of the role of Mg as a stabilizing impurity in beta-Ca3(PO4)2. II. Refinement of Mg-containing beta-Ca3(PO4)2 Sample: x = 0.11 Mg Note: changed sign of O3(y) to match bond distances Journal of Solid State Chemistry, 1977, 22, 253-262 |
| 9012137 | CIF | Ca9.5 Mg O28 P7 | R 3 c :H | 10.337; 10.337; 37.068 90; 90; 120 | 3430.2 | Schroeder, L. W.; Dickens, B.; Brown, W. E. Crystallographic studies of the role of Mg as a stabilizing impurity in beta-Ca3(PO4)2. II. Refinement of Mg-containing beta-Ca3(PO4)2 Sample: x = 0.29 Mg Journal of Solid State Chemistry, 1977, 22, 253-262 |
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